Geometry & MOs

Info

ID:	360755
PubChem CID:	127301400
Reduced:	SN2O3C12H20 (1)
Stoich.:	AB2C3D12E20 (1)
Weight, g/mol:	272.119464
ΔH_f, kcal/mol:	-92.67
Dipole, Da:	3.31
IP(EA), eV:	-9.56(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3,5-dimethylpiperidin-1-yl)sulfonylmethyl]-3-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

CC1CC(CN(C1)S(=O)(=O)CC2=NOC(=C2)C)C

DOS

IR

Vibrations